platinum(4+);1-(trideuteriomethyl)-3-[3-[1-(trideuteriomethyl)-2H-imidazo[4,5-b]pyridin-2-id-3-yl]-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-2H-imidazo[4,5-b]pyridin-2-ide;3-(trifluoromethyl)carbazol-9-ide

C48H46F3N7Pt — CID 155650536

About platinum(4+);1-(trideuteriomethyl)-3-[3-[1-(trideuteriomethyl)-2H-imidazo[4,5-b]pyridin-2-id-3-yl]-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-2H-imidazo[4,5-b]pyridin-2-ide;3-(trifluoromethyl)carbazol-9-ide

platinum(4+);1-(trideuteriomethyl)-3-[3-[1-(trideuteriomethyl)-2H-imidazo[4,5-b]pyridin-2-id-3-yl]-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-2H-imidazo[4,5-b]pyridin-2-ide;3-(trifluoromethyl)carbazol-9-ide (PubChem CID 155650536) has the molecular formula C48H46F3N7Pt and a molecular weight of 979.05 g/mol. Its IUPAC name is platinum(4+);1-(trideuteriomethyl)-3-[3-[1-(trideuteriomethyl)-2H-imidazo[4,5-b]pyridin-2-id-3-yl]-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-2H-imidazo[4,5-b]pyridin-2-ide;3-(trifluoromethyl)carbazol-9-ide.

Molecular Properties

• Compound Name: platinum(4+);1-(trideuteriomethyl)-3-[3-[1-(trideuteriomethyl)-2H-imidazo[4,5-b]pyridin-2-id-3-yl]-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-2H-imidazo[4,5-b]pyridin-2-ide;3-(trifluoromethyl)carbazol-9-ide
• PubChem CID: 155650536
• Molecular Formula: C48H46F3N7Pt
• Molecular Weight: 979.05 g/mol
• Exact Mass: 978.38
• IUPAC Name: platinum(4+);1-(trideuteriomethyl)-3-[3-[1-(trideuteriomethyl)-2H-imidazo[4,5-b]pyridin-2-id-3-yl]-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-2H-imidazo[4,5-b]pyridin-2-ide;3-(trifluoromethyl)carbazol-9-ide
• SMILES: FC(F)(F)c1ccc2[n-]c3ccccc3c2c1.[2H]C([2H])([2H])N1[CH-]N(c2[c-]c(N3[CH-]N(C([2H])([2H])[2H])c4cccnc43)cc(-c3c(C(C)C)cc(C(C)C)cc3C(C)C)c2)c2ncccc21.[Pt+4]
• InChI: InChI=1S/C35H39N6.C13H7F3N.Pt/c1-22(2)25-17-29(23(3)4)33(30(18-25)24(5)6)26-15-27(40-20-38(7)31-11-9-13-36-34(31)40)19-28(16-26)41-21-39(8)32-12-10-14-37-35(32)41;14-13(15,16)8-5-6-12-10(7-8)9-3-1-2-4-11(9)17-12;/h9-18,20-24H,1-8H3;1-7H;/q-3;-1;+4/i7D3,8D3
• InChIKey: NNVSZOYTRHSDGE-KRNBNSPWSA-N
• XLogP: 12.69
• TPSA: 52.84 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 8
• Heavy Atoms: 59
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	979.05
LogP ≤ 5	12.69
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of platinum(4+);1-(trideuteriomethyl)-3-[3-[1-(trideuteriomethyl)-2H-imidazo[4,5-b]pyridin-2-id-3-yl]-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-2H-imidazo[4,5-b]pyridin-2-ide;3-(trifluoromethyl)carbazol-9-ide?

The IUPAC name of platinum(4+);1-(trideuteriomethyl)-3-[3-[1-(trideuteriomethyl)-2H-imidazo[4,5-b]pyridin-2-id-3-yl]-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-2H-imidazo[4,5-b]pyridin-2-ide;3-(trifluoromethyl)carbazol-9-ide (CID 155650536) is platinum(4+);1-(trideuteriomethyl)-3-[3-[1-(trideuteriomethyl)-2H-imidazo[4,5-b]pyridin-2-id-3-yl]-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-2H-imidazo[4,5-b]pyridin-2-ide;3-(trifluoromethyl)carbazol-9-ide.

What is the SMILES notation for platinum(4+);1-(trideuteriomethyl)-3-[3-[1-(trideuteriomethyl)-2H-imidazo[4,5-b]pyridin-2-id-3-yl]-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-2H-imidazo[4,5-b]pyridin-2-ide;3-(trifluoromethyl)carbazol-9-ide?

The canonical SMILES for platinum(4+);1-(trideuteriomethyl)-3-[3-[1-(trideuteriomethyl)-2H-imidazo[4,5-b]pyridin-2-id-3-yl]-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-2H-imidazo[4,5-b]pyridin-2-ide;3-(trifluoromethyl)carbazol-9-ide is FC(F)(F)c1ccc2[n-]c3ccccc3c2c1.[2H]C([2H])([2H])N1[CH-]N(c2[c-]c(N3[CH-]N(C([2H])([2H])[2H])c4cccnc43)cc(-c3c(C(C)C)cc(C(C)C)cc3C(C)C)c2)c2ncccc21.[Pt+4].

What is the InChIKey of platinum(4+);1-(trideuteriomethyl)-3-[3-[1-(trideuteriomethyl)-2H-imidazo[4,5-b]pyridin-2-id-3-yl]-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-2H-imidazo[4,5-b]pyridin-2-ide;3-(trifluoromethyl)carbazol-9-ide?

The InChIKey is NNVSZOYTRHSDGE-KRNBNSPWSA-N. The full InChI is InChI=1S/C35H39N6.C13H7F3N.Pt/c1-22(2)25-17-29(23(3)4)33(30(18-25)24(5)6)26-15-27(40-20-38(7)31-11-9-13-36-34(31)40)19-28(16-26)41-21-39(8)32-12-10-14-37-35(32)41;14-13(15,16)8-5-6-12-10(7-8)9-3-1-2-4-11(9)17-12;/h9-18,20-24H,1-8H3;1-7H;/q-3;-1;+4/i7D3,8D3;;.

What are the key properties of platinum(4+);1-(trideuteriomethyl)-3-[3-[1-(trideuteriomethyl)-2H-imidazo[4,5-b]pyridin-2-id-3-yl]-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-2H-imidazo[4,5-b]pyridin-2-ide;3-(trifluoromethyl)carbazol-9-ide?

platinum(4+);1-(trideuteriomethyl)-3-[3-[1-(trideuteriomethyl)-2H-imidazo[4,5-b]pyridin-2-id-3-yl]-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-2H-imidazo[4,5-b]pyridin-2-ide;3-(trifluoromethyl)carbazol-9-ide has a molecular weight of 979.05 g/mol, XLogP of 12.69, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for platinum(4+);1-(trideuteriomethyl)-3-[3-[1-(trideuteriomethyl)-2H-imidazo[4,5-b]pyridin-2-id-3-yl]-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-2H-imidazo[4,5-b]pyridin-2-ide;3-(trifluoromethyl)carbazol-9-ide is sourced from PubChem (CID 155650536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).